3-fluoro-5-propoxypyridin-2-amine

C8H11FN2O — CID 123816100

IUPAC3-fluoro-5-propoxypyridin-2-amine
SMILESCCCOc1cnc(N)c(F)c1
InChIInChI=1S/C8H11FN2O/c1-2-3-12-6-4-7(9)8(10)11-5-6/h4-5H,2-3H2,1H3,(H2,10,11)
InChIKeyOBWHFVLCKIWDSR-UHFFFAOYSA-N
MW170.19 g/mol
LogP1.59
Rot. Bonds3

About 3-fluoro-5-propoxypyridin-2-amine

3-fluoro-5-propoxypyridin-2-amine (PubChem CID 123816100) has the molecular formula C8H11FN2O and a molecular weight of 170.19 g/mol. Its IUPAC name is 3-fluoro-5-propoxypyridin-2-amine.

Molecular Properties

Compound Name3-fluoro-5-propoxypyridin-2-amine
PubChem CID123816100
Molecular FormulaC8H11FN2O
Molecular Weight170.19 g/mol
Exact Mass170.09
IUPAC Name3-fluoro-5-propoxypyridin-2-amine
SMILESCCCOc1cnc(N)c(F)c1
InChIInChI=1S/C8H11FN2O/c1-2-3-12-6-4-7(9)8(10)11-5-6/h4-5H,2-3H2,1H3,(H2,10,11)
InChIKeyOBWHFVLCKIWDSR-UHFFFAOYSA-N
XLogP1.59
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.19
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-propoxypyridin-2-amine?
The IUPAC name of 3-fluoro-5-propoxypyridin-2-amine (CID 123816100) is 3-fluoro-5-propoxypyridin-2-amine.
What is the SMILES notation for 3-fluoro-5-propoxypyridin-2-amine?
The canonical SMILES for 3-fluoro-5-propoxypyridin-2-amine is CCCOc1cnc(N)c(F)c1.
What is the InChIKey of 3-fluoro-5-propoxypyridin-2-amine?
The InChIKey is OBWHFVLCKIWDSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2O/c1-2-3-12-6-4-7(9)8(10)11-5-6/h4-5H,2-3H2,1H3,(H2,10,11).
What are the key properties of 3-fluoro-5-propoxypyridin-2-amine?
3-fluoro-5-propoxypyridin-2-amine has a molecular weight of 170.19 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-propoxypyridin-2-amine is sourced from PubChem (CID 123816100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).